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Ammonium, diethyl(2-(4-(2-ethoxybenzamido)benzoyloxy)ethyl)methyl-, iodide

HCID 117724
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Basic information

CAS
26095-53-4
Standard SMILES
CCOc1ccccc1C(=O)Nc1ccc(C(=O)OCC[N+](C)(CC)CC)cc1.[I-]
InChIKey
SOMYIYRZWSLPBU-UHFFFAOYSA-N
Molecular formula
C23H31IN2O4
Average molar mass
526.4 g/mol
Monoisotopic mass
526.13286

Names & identifiers

Preferred name
Ammonium, diethyl(2-(4-(2-ethoxybenzamido)benzoyloxy)ethyl)methyl-, iodide
IUPAC
2-[4-[(2-ethoxybenzoyl)amino]benzoyl]oxyethyl-diethyl-methylazanium iodide

Names & synonyms

Diethyl(2-(4-(2-ethoxybenzamido)benzoyloxy)ethyl)methylammonium iodideAmmonium, diethyl(2-(4-(2-ethoxybenzamido)benzoyloxy)ethyl)methyl-, iodide26095-53-4RefChem:319209

Database identifiers

CAS
26095-53-4
PubChem CID
117724

Properties

Computed structural properties

Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
11
Heavy atoms
30
Formal charge
0
Complexity
513

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